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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02812921

You can sort the columns by Ligand, Ligand name, PDB and Tanimoto.


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
1GPSN-GLYCEROL-1-PHOSPHATEA,B2F6X0.81
1GPSN-GLYCEROL-1-PHOSPHATEA,B,C,D2VYV0.81
CDI2C-METHYL-D-ERYTHRITOL 2,4-CYCLODIPHOSPHATEA1KNJ0.77
CDI2C-METHYL-D-ERYTHRITOL 2,4-CYCLODIPHOSPHATEA,B,C,D,E,F,
G,H
1H480.77
CDI2C-METHYL-D-ERYTHRITOL 2,4-CYCLODIPHOSPHATEA1JY80.77
B1P2-DEOXY-5-O-PHOSPHONO-BETA-D-ERYTHRO-
PENTOFURANOSE
A2O7X0.76
B1P2-DEOXY-5-O-PHOSPHONO-BETA-D-ERYTHRO-
PENTOFURANOSE
A2HSR0.76
B1P2-DEOXY-5-O-PHOSPHONO-BETA-D-ERYTHRO-
PENTOFURANOSE
A2O820.76
B1P2-DEOXY-5-O-PHOSPHONO-BETA-D-ERYTHRO-
PENTOFURANOSE
A2O7Z0.76
B1P2-DEOXY-5-O-PHOSPHONO-BETA-D-ERYTHRO-
PENTOFURANOSE
A2HSS0.76
4IPINOSITOL-(1,3,4,5)-TETRAKISPHOSPHATEA1U270.8
4IPINOSITOL-(1,3,4,5)-TETRAKISPHOSPHATEA1FAO0.8
4IPINOSITOL-(1,3,4,5)-TETRAKISPHOSPHATEA2UZS0.8
4IPINOSITOL-(1,3,4,5)-TETRAKISPHOSPHATEA1H100.8
4IPINOSITOL-(1,3,4,5)-TETRAKISPHOSPHATEA,B2R0D0.8
4IPINOSITOL-(1,3,4,5)-TETRAKISPHOSPHATEA,B1B550.8
4IPINOSITOL-(1,3,4,5)-TETRAKISPHOSPHATEA1W1D0.8
4IPINOSITOL-(1,3,4,5)-TETRAKISPHOSPHATEA,B1BWN0.8
4IPINOSITOL-(1,3,4,5)-TETRAKISPHOSPHATEA,B1W2D0.8
4IPINOSITOL-(1,3,4,5)-TETRAKISPHOSPHATEA,B1FHX0.8
4IPINOSITOL-(1,3,4,5)-TETRAKISPHOSPHATEA,B2R090.8
4IPINOSITOL-(1,3,4,5)-TETRAKISPHOSPHATEA1UNQ0.8
4IPINOSITOL-(1,3,4,5)-TETRAKISPHOSPHATEA1UPR0.8
4IPINOSITOL-(1,3,4,5)-TETRAKISPHOSPHATEA1FGY0.8
2IPD-MYO-INOSITOL-1,4-BISPHOSPHATEA1I9Z0.86
ABFBETA-D-ARABINOFURANOSE-5'-PHOSPHATEA,B,E,F1O8B0.78
A6P6-O-phosphono-alpha-D-allopyranoseA,B,C,D,E2VVO0.73
AHM2,5-ANHYDROMANNITOL-1,6-DIPHOSPHATEA,B1FBG0.8
AHM2,5-ANHYDROMANNITOL-1,6-DIPHOSPHATEA,B1FBF0.8
BLT1,4-DIDEOXY-1,4-[[2R,3R)-2,4-DIHYDROXY-
3-(SULFOXY)BUTYL]EPISELENONIUMYLIDENE]-
D-ARABINITOL INNER SALT
A1TQW0.71
AHG2,5-ANHYDROGLUCITOL-1,6-BIPHOSPHATEA,B1FBD0.8
AHG2,5-ANHYDROGLUCITOL-1,6-BIPHOSPHATEA,B1FBE0.8
AHG2,5-ANHYDROGLUCITOL-1,6-BIPHOSPHATEA,B1FPE0.8
AHG2,5-ANHYDROGLUCITOL-1,6-BIPHOSPHATEA,B1FPD0.8
AHG2,5-ANHYDROGLUCITOL-1,6-BIPHOSPHATEA,B1FBC0.8
AHG2,5-ANHYDROGLUCITOL-1,6-BIPHOSPHATEA,B1FPG0.8
AHG2,5-ANHYDROGLUCITOL-1,6-BIPHOSPHATEA,B1FPL0.8
AHG2,5-ANHYDROGLUCITOL-1,6-BIPHOSPHATEA,B1FPI0.8
AHG2,5-ANHYDROGLUCITOL-1,6-BIPHOSPHATEA,B1FPJ0.8
AHG2,5-ANHYDROGLUCITOL-1,6-BIPHOSPHATEA,B1FPF0.8
CAK[(1R,2R,3S,4S,5R)-2,3,4,5-TETRAHYDROXYCYCLOHEXYL]METHYL DIHYDROGEN PHOSPHATEA,B2GRU0.73
CBU(1R,2R,3S,4S,5S,6S)-CYCLOHEXANE-
1,2,3,4,5,6-HEXOL
A,B2VT00.71
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,B,F1OE50.83
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,B,C,D,E,F,
G,H,I,J,K,L
1Q9X0.83
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,B,C2NP70.83
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,D1PM50.83
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,B2OFI0.83
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,B,F1OE40.83
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEU,X1DE80.83
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,B1FZS0.83
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,C2NQ90.83
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,B,C,D,E,F2NP60.83
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATED1PHJ0.83
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,B,C2NQJ0.83
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,P,T2OZM0.83
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEC1N390.83
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEC1N3A0.83
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,B,V,Y1DE90.83
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,C2IH50.83
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,B,C,D,E,I2P5O0.83
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,B1FZL0.83
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,B,C,D,I2P5G0.83
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,B,C,D1M5R0.83
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,B,C1Y6F0.83
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,B1P5W0.83
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,D9MHT0.83
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,P,T3G6X0.83
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,P,T3G6V0.83
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,D1PJJ0.83
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,B1YCT0.83
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,P,T3G6Y0.83
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATED2RBA0.83
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATED1FN70.83
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEX1M060.83
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,B,C1P590.83
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEB,U,X1DEW0.83
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,B1HT40.83
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,C1QUM0.83
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,B1YCW0.83
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,B,C,D1IXY0.83
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,B,C1N480.83
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,C,E,F,I,J,K2OYQ0.83
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,F1OE60.83
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEE,G,I,K2DTU0.83
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,D,G,H1PH50.83
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,B1HT70.83
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,G3EI20.83
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,B,D,F1N560.83
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,B,C,D,E,F2IBT0.83
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,C,D2P660.83
BGPBETA-GALACTOSE-6-PHOSPHATEA,B4PBG0.73
A5PARABINOSE-5-PHOSPHATEA1UJ61
A5PARABINOSE-5-PHOSPHATEA,B1FXQ1
A5PARABINOSE-5-PHOSPHATEA,B,C,D,E,F,
G,H,I,J,K,L
2NX31
A5PARABINOSE-5-PHOSPHATEA,B1LRQ1
A5PARABINOSE-5-PHOSPHATEA,B2CXP1
A5PARABINOSE-5-PHOSPHATEA,B1T8X1
A5PARABINOSE-5-PHOSPHATEA,B2EF91
A5PARABINOSE-5-PHOSPHATEA,B1FY61
A5PARABINOSE-5-PHOSPHATEA,B2NWS1
A5PARABINOSE-5-PHOSPHATEA,B2NXG1
A5PARABINOSE-5-PHOSPHATEA,B2A2I1
A5PARABINOSE-5-PHOSPHATEA,B1FWW1
AFPALPHA FRUCTOSE 1,6-DIPHOSPHATEA,B1FBH0.75
AFPALPHA FRUCTOSE 1,6-DIPHOSPHATEA1LLC0.75
BG6BETA-D-GLUCOSE-6-PHOSPHATEA2CIR0.73
BG6BETA-D-GLUCOSE-6-PHOSPHATEA,B3BXG0.73
BG6BETA-D-GLUCOSE-6-PHOSPHATEA,B,C,D2POC0.73
BG6BETA-D-GLUCOSE-6-PHOSPHATEA,B2PUW0.73
BG6BETA-D-GLUCOSE-6-PHOSPHATEA1E7Y0.73
BG6BETA-D-GLUCOSE-6-PHOSPHATEA,B2NZT0.73
BG6BETA-D-GLUCOSE-6-PHOSPHATEA1E770.73
BG6BETA-D-GLUCOSE-6-PHOSPHATEA,B2BHL0.73
BG6BETA-D-GLUCOSE-6-PHOSPHATEA,B2Q8M0.73
BG6BETA-D-GLUCOSE-6-PHOSPHATEG,L2NZU0.73
AAB2-DEOXY-5-PHOSPHORIBOSE GROUPA1A9J0.76
AAB2-DEOXY-5-PHOSPHORIBOSE GROUPC,D1MTL0.76
AAB2-DEOXY-5-PHOSPHORIBOSE GROUPB,C2OYT0.76
AAB2-DEOXY-5-PHOSPHORIBOSE GROUPA1G5E0.76
AAB2-DEOXY-5-PHOSPHORIBOSE GROUPD1MWI0.76
AAB2-DEOXY-5-PHOSPHORIBOSE GROUPA1A9I0.76
AAB2-DEOXY-5-PHOSPHORIBOSE GROUPA1GJ00.76
AAB2-DEOXY-5-PHOSPHORIBOSE GROUPB1SJL0.76
AAB2-DEOXY-5-PHOSPHORIBOSE GROUPA2SSP0.76
AAB2-DEOXY-5-PHOSPHORIBOSE GROUPA1A9G0.76
AAB2-DEOXY-5-PHOSPHORIBOSE GROUPA1A9H0.76
5RPRIBULOSE-5-PHOSPHATEA,B1XBY0.78
5RPRIBULOSE-5-PHOSPHATEA,B1XBX0.78
5RPRIBULOSE-5-PHOSPHATEA1UJ50.78
5RPRIBULOSE-5-PHOSPHATEA,B1PVY0.78
5RPRIBULOSE-5-PHOSPHATEA2RIU0.78
5RPRIBULOSE-5-PHOSPHATEA,B1SNN0.78
5RPRIBULOSE-5-PHOSPHATEA,B1TKU0.78
5RPRIBULOSE-5-PHOSPHATEA,B3HHE0.78
5RPRIBULOSE-5-PHOSPHATEA,B1XBV0.78
5RPRIBULOSE-5-PHOSPHATEA,B,C2ISS0.78
5RPRIBULOSE-5-PHOSPHATEA,B,C2IYP0.78
5RPRIBULOSE-5-PHOSPHATEA,B,C,D,E2VVP0.78
5IP(1R,2R,3R,4R,5S,6S)-6-HYDROXYCYCLOHEXANE-
1,2,3,4,5-PENTAYL PENTAKIS[DIHYDROGEN (PHOSPHATE)]
A2I5F0.8